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MolNFT v1 · #173113 · protein + DNA

Bovine papillomavirus E1 DNA helicase-replication fork complex

7APD · Replication protein E1: “Bovine papillomavirus E1 DNA helicase-replication fork complex”. Electron microscopy, 20 pockets (best druggability 0.85). MolNFT v1 #173113 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7APD
Type
protein + DNA
Length
2,096 residues
Chains
10
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Replication protein E1; DNA (40-mer); DNA (36-mer)
EC
3.6.4.12
UniProt
C5IAS0, P03116
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 8 distinct chains · 43% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
GReplication protein E1 (EC 3.6.4.12)protein15230% helix, 20% strandC5IAS0
BReplication protein E1 (EC 3.6.4.12)protein28948% helix, 9% strandP03116
C, D, EReplication protein E1 (EC 3.6.4.12)protein28745% helix, 9% strandP03116
FReplication protein E1 (EC 3.6.4.12)protein28647% helix, 9% strandP03116
AReplication protein E1 (EC 3.6.4.12)protein28444% helix, 7% strandP03116
HReplication protein E1 (EC 3.6.4.12)protein14837% helix, 28% strandC5IAS0
PDNA (40-mer)dna40——
TDNA (36-mer)dna36——

Pockets

20 pockets found on a 1 Å grid, 14 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111200.850.86148empty
25450.760.8354empty
34620.760.8470empty
4940.750.9628empty
53770.710.8339empty

Interfaces

21 interfaces between chains.

  • C–D · 1645 Ų buried · 13 hydrogen bonds · protein-protein
  • B–C · 1549 Ų buried · 5 hydrogen bonds · protein-protein
  • D–E · 1525 Ų buried · 5 hydrogen bonds · protein-protein
  • E–F · 1415 Ų buried · 6 hydrogen bonds · protein-protein
  • F–A · 1410 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 7APD · Bovine Papillomavirus E1 DNA helicase-replication fork complex · the same entry in another collection · chain G against G, TM-score 1.00

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